5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H22O8
Molecular Weight	414.4053
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-

Structure Search

SMILES

[H][C@]12COC(=O)[C@]1([H])[C@H](C3=CC(OC)=C(O)C(OC)=C3)C4=C(C=C5OCOC5=C4)[C@H]2OC

InChI

InChIKey=AMTKNUDRCUERFP-DXRQPORESA-N

InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)20(16)23)18-11-6-14-15(30-9-29-14)7-12(11)21(27-3)13-8-28-22(24)19(13)18/h4-7,13,18-19,21,23H,8-9H2,1-3H3/t13-,18+,19-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H22O8
Molecular Weight	414.4053
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:17:55 UTC 2023` Edited by `admin` on `Sat Dec 16 15:17:55 UTC 2023`
Record UNII	UY5BXI2HZ5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-

Systematic Name

English

ETOPOSIDE IMPURITY J [EP IMPURITY]

Common Name

English

(5R,5AR,8AR,9S)-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-5,8,8A,9-TETRAHYDRO(2)BENZOFURO(5,6-F)(1,3)BENZODIOXOL-6(5AH)-ONE

Systematic Name

English

FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, 5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-9-METHOXY-, (5R-(5.ALPHA.,5A.BETA.,8A.ALPHA.,9.BETA.))-

Systematic Name

English

Code System Code Type Description

PUBCHEM

15621809

Created by admin on Sat Dec 16 15:17:55 UTC 2023 , Edited by admin on Sat Dec 16 15:17:55 UTC 2023

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CAS

118356-05-1

Created by admin on Sat Dec 16 15:17:55 UTC 2023 , Edited by admin on Sat Dec 16 15:17:55 UTC 2023

PRIMARY

FDA UNII

UY5BXI2HZ5

Created by admin on Sat Dec 16 15:17:55 UTC 2023 , Edited by admin on Sat Dec 16 15:17:55 UTC 2023

PRIMARY

Related Record Type Details


					6PLQ3CP4P3

ETOPOSIDE

PARENT -> IMPURITY

Amount: